Information card for entry 2007749

Structure parameters

• Formula: C26 H28 N2 O2
• Calculated formula: C26 H28 N2 O2
• SMILES: O=C1NC(=C2C(=O)NC(=C12)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C
• Title of publication: 3,6-Bis(4-<i>tert</i>-butylphenyl)-1,2,4,5-tetrahydropyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione
• Authors of publication: Mizuguchi, Jin
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 10
• Pages of publication: 1482 - 1484
• a: 9.872 ± 0.001 Å
• b: 15.779 ± 0.001 Å
• c: 7.229 ± 0.001 Å
• α: 96.31 ± 0.01°
• β: 91.13 ± 0.01°
• γ: 82.2 ± 0.01°
• Cell volume: 1108.9 ± 0.2 ų
• Cell temperature: 298.2 K
• Ambient diffraction temperature: 298.2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.087
• Goodness-of-fit parameter for significantly intense reflections: 1.286
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No